2-[(4-bromophenoxy)methyl]-9-(difluoromethyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-[(4-bromophenoxy)methyl]-9-(difluoromethyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-[(4-bromophenoxy)methyl]-9-(difluoromethyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | D643-0120 |
| Compound Name: | 2-[(4-bromophenoxy)methyl]-9-(difluoromethyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 476.3 |
| Molecular Formula: | C19 H12 Br F2 N5 O S |
| Smiles: | Cc1cc(C(F)F)nc2c1c1c(c3nc(COc4ccc(cc4)[Br])nn3cn1)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.9217 |
| logD: | 4.9204 |
| logSw: | -4.9224 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.71 |
| InChI Key: | ZECJHKDIWOMDKQ-UHFFFAOYSA-N |